1-[5-methyl-1-(4-nitrophenyl)-3-thiophen-2-yl-pyrazol-4-yl]ethanone

Systemtic Name: 1-[5-methyl-1-(4-nitrophenyl)-3-thiophen-2-yl-pyrazol-4-yl]ethanone Openeye Name: 1-[5-methyl-1-(4-nitrophenyl)-3-(2-thienyl)pyrazol-4-yl]ethanone CAS Name: 1-[5-methyl-1-(4-nitrophenyl)-3-thiophen-2-yl-4-pyrazolyl]ethanone IUPAC Name: 1-[5-methyl-1-(4-nitrophenyl)-3-thiophen-2-ylpyrazol-4-yl]ethanone Traditional Name: 1-[5-methyl-1-(4-nitrophenyl)-3-(2-thienyl)pyrazol-4-yl]ethanone Formula: C16H13N3O3S MolecularWeight: 327.35772

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CS3)C(=O)C

Isomeric SMILES

CC1=C(C(=NN1C2=CC=C(C=C2)[N+](=O)[O-])C3=CC=CS3)C(=O)C

InChI

InChI=1S/C16H13N3O3S/c1-10-15(11(2)20)16(14-4-3-9-23-14)17-18(10)12-5-7-13(8-6-12)19(21)22/h3-9H,1-2H3